6-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 6-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 6-(2-ethoxy-2-oxo-ethyl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 6-(2-ethoxy-2-oxoethyl)-5-methyl-3-phenyl-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 6-(2-ethoxy-2-oxoethyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 6-(2-ethoxy-2-keto-ethyl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate Formula: C17H16N3O3- MolecularWeight: 310.32724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N2C(=C(C=N2)C3=CC=CC=C3)N=C1C)[O-]

Isomeric SMILES

CCOC(=O)CC1=C(N2C(=C(C=N2)C3=CC=CC=C3)N=C1C)[O-]

InChI

InChI=1S/C17H17N3O3/c1-3-23-15(21)9-13-11(2)19-16-14(10-18-20(16)17(13)22)12-7-5-4-6-8-12/h4-8,10,22H,3,9H2,1-2H3/p-1